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Home > Encyclopedia > [2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl] 3,4,5-triacetyloxybenzoate

[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl] 3,4,5-triacetyloxybenzoate

[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl] 3,4,5-triacetyloxybenzoate structure

[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl] 3,4,5-triacetyloxybenzoate 

structure
  • CAS No:

    521280-13-7

  • Formula:

    C24H23NO9

  • Chemical Name:

    [2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl] 3,4,5-triacetyloxybenzoate

  • Synonyms:

    SMR001314466;MLS002252117;MLS003912748;CHEMBL1439507;HMS3089B22;ZINC3241097;AKOS001017699;MCULE-4464022717;Z56841577;2-oxo-2-(1,2,3,4-tetrahydroisoquinolin-2-yl)ethyl 3,4,5-tris(acetyloxy)benzoate;521280-13-7

[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl] 3,4,5-triacetyloxybenzoate Basic Attributes

469.4 g/mol

469.13728131 g/mol

Characteristics

126 Ų

>70.4 [ug/mL]

Computed Properties

Molecular Weight:469.4
XLogP3:2.1
Hydrogen Bond Acceptor Count:9
Rotatable Bond Count:10
Exact Mass:469.13728131
Monoisotopic Mass:469.13728131
Topological Polar Surface Area:126
Heavy Atom Count:34
Complexity:771
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Guide of [2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl] 3,4,5-triacetyloxybenzoate

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